N-(7-chloranyl-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)-N,1-dimethyl-piperidin-4-amine

Systemtic Name: N-(7-chloranyl-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)-N,1-dimethyl-piperidin-4-amine Openeye Name: N-(7-chloro-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)-N,1-dimethyl-piperidin-4-amine CAS Name: N-(7-chloro-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)-N,1-dimethyl-4-piperidinamine IUPAC Name: N-(7-chloro-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)-N,1-dimethylpiperidin-4-amine Traditional Name: (7-chloro-5-nitro-1,2,3,4-tetrahydroxanthen-4a-yl)-methyl-(1-methyl-4-piperidyl)amine Formula: C20H26ClN3O3 MolecularWeight: 391.89174

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Descriptors Computed from Structure

Canonical SMILES:

CN1CCC(CC1)N(C)C23CCCCC2=CC4=CC(=CC(=C4O3)[N+](=O)[O-])Cl

Isomeric SMILES

CN1CCC(CC1)N(C)C23CCCCC2=CC4=CC(=CC(=C4O3)[N+](=O)[O-])Cl

InChI

InChI=1S/C20H26ClN3O3/c1-22-9-6-17(7-10-22)23(2)20-8-4-3-5-15(20)11-14-12-16(21)13-18(24(25)26)19(14)27-20/h11-13,17H,3-10H2,1-2H3